Identifier Cleaner
Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.
Example: aspirin
→ CC(=O)Oc1ccccc1C(=O)O
Cc1cc(OCCN2CCC(n3cnc4cccnc43)CC2)nn1-c1ccc(Cl)c(Cl)c1
InChI=1S/C23H24Cl2N6O/c1-16-13-22(28-31(16)18-4-5-19(24)20(25)14-18)32-12-11-29-9-6-17(7-10-29)30-15-27-21-3-2-8-26-23(21)30/h2-5,8,13-15,17H,6-7,9-12H2,1H3
JUIHLROADBKASM-UHFFFAOYSA-N
471.39